Match comparison for Energy [step 20] (match type 30242)

Commits > Commit bb161c2d0107cec853e686df3a469ebc444968d7 > Input 14-fullerene_unpacked.03-td-packed.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-3.184094654954693e+02 3.380000000000000e-11 -3.184094654954730e+02 7.038392124496022e-12 -3.184094654954746e+02 1.415401129634120e-11 PASS

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Detailed information

Reference: -318.4094654954693, precision: 0.0000000000338
Run Value Difference Relative difference Status
foss_cmake: [foss2022a-serial, foss-min] -3.184094654954605e+02 8.810729923425242e-12 2.606724829415752e-01 PASS
foss_min_autotools: [foss2023a-serial] -3.184094654954703e+02 -9.663381206337363e-13 -2.858988522585018e-02 PASS
foss_cmake: [foss2022a-serial, foss-full] -3.184094654954605e+02 8.810729923425242e-12 2.606724829415752e-01 PASS
foss_min_autotools: [foss2023b-serial] -3.184094654954703e+02 -9.663381206337363e-13 -2.858988522585018e-02 PASS
foss_min_autotools: [foss2022a-serial] -3.184094654954703e+02 -9.663381206337363e-13 -2.858988522585018e-02 PASS
foss_autotools: [foss2022a-serial] -3.184094654954703e+02 -9.663381206337363e-13 -2.858988522585018e-02 PASS
foss_opt_autotools: [foss2023a-serial] -3.184094654954605e+02 8.810729923425242e-12 2.606724829415752e-01 PASS
foss_cmake_mpi_min: [foss2023a-mpi] -3.184094654954749e+02 -5.627498467219993e-12 -1.664940374917158e-01 PASS
foss_cmake_mpi_min: [foss2022a-mpi] -3.184094654954713e+02 -1.989519660128281e-12 -5.886152840616214e-02 PASS
foss_autotools: [foss2023b-serial] -3.184094654954703e+02 -9.663381206337363e-13 -2.858988522585018e-02 PASS
intel_autotools: [intel2023a-serial] -3.184094654954738e+02 -4.490630090003833e-12 -1.328588784024803e-01 PASS
foss_autotools: [foss2023a-serial] -3.184094654954703e+02 -9.663381206337363e-13 -2.858988522585018e-02 PASS
foss_mpi_min_autotools: [foss2023a-mpi] -3.184094654954888e+02 -1.949729266925715e-11 -5.768429783803890e-01 PASS
foss_omp_autotools: [foss2023a-serial] -3.184094654954627e+02 6.593836587853730e-12 1.950839227175659e-01 PASS
foss_mpi_min_autotools: [foss2022a-mpi] -3.184094654954888e+02 -1.949729266925715e-11 -5.768429783803890e-01 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -3.184094654954741e+02 -4.831690603168681e-12 -1.429494261292509e-01 PASS
foss_mpi_opt_autotools: [foss2023a-mpi] -3.184094654954790e+02 -9.720224625198171e-12 -2.875806102129636e-01 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -3.184094654954777e+02 -8.355982572538778e-12 -2.472184193058810e-01 PASS
intel_omp_autotools: [intel2023a-serial] -3.184094654954678e+02 1.534772309241816e-12 4.540746477046794e-02 PASS
foss_mpi_autotools: [foss2023a-mpi] -3.184094654954793e+02 -9.947598300641403e-12 -2.943076420308107e-01 PASS
foss_mpi_autotools: [foss2022a-mpi] -3.184094654954771e+02 -7.787548383930698e-12 -2.304008397612632e-01 PASS
intel_omp_autotools: [intel2022a-serial] -3.184094654954766e+02 -7.332801033044234e-12 -2.169467761255690e-01 PASS
foss_debug_autotools: [foss2023a-serial] -3.184094654954703e+02 -9.663381206337363e-13 -2.858988522585018e-02 PASS
foss_ppc_autotools: [foss2022a-serial] -3.184094654954775e+02 -8.242295734817162e-12 -2.438549033969575e-01 PASS
intel_mpi_autotools: [intel2023a-mpi] -3.184094654954632e+02 6.082245818106458e-12 1.799481011274100e-01 PASS
foss_mpi_debug_autotools: [foss2023a-mpi] -3.184094654954785e+02 -9.151790436590090e-12 -2.707630306683458e-01 PASS
foss_cuda_autotools: [foss2022a-cuda-mpi] -3.184094654954773e+02 -7.958078640513122e-12 -2.354461136246486e-01 PASS
foss_mpi_omp_autotools: [foss2023a-mpi] -3.184094654954754e+02 -6.082245818106458e-12 -1.799481011274100e-01 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] -3.184094654954777e+02 -8.355982572538778e-12 -2.472184193058810e-01 PASS
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] -3.184094654954752e+02 -5.911715561524034e-12 -1.749028272640246e-01 PASS